2-methoxy-5-(oxan-2-yloxy)phenol

C12H16O4 — CID 163802207

IUPAC2-methoxy-5-(oxan-2-yloxy)phenol
SMILESCOc1ccc(OC2CCCCO2)cc1O
InChIInChI=1S/C12H16O4/c1-14-11-6-5-9(8-10(11)13)16-12-4-2-3-7-15-12/h5-6,8,12-13H,2-4,7H2,1H3
InChIKeyNFYUNEXPWUSASF-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.31
Rot. Bonds3

About 2-methoxy-5-(oxan-2-yloxy)phenol

2-methoxy-5-(oxan-2-yloxy)phenol (PubChem CID 163802207) has the molecular formula C12H16O4 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-methoxy-5-(oxan-2-yloxy)phenol.

Molecular Properties

Compound Name2-methoxy-5-(oxan-2-yloxy)phenol
PubChem CID163802207
Molecular FormulaC12H16O4
Molecular Weight224.26 g/mol
Exact Mass224.10
IUPAC Name2-methoxy-5-(oxan-2-yloxy)phenol
SMILESCOc1ccc(OC2CCCCO2)cc1O
InChIInChI=1S/C12H16O4/c1-14-11-6-5-9(8-10(11)13)16-12-4-2-3-7-15-12/h5-6,8,12-13H,2-4,7H2,1H3
InChIKeyNFYUNEXPWUSASF-UHFFFAOYSA-N
XLogP2.31
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(oxan-2-yloxy)phenol
CID 11745519
2-(3,4-dimethylphenoxy)oxane
CID 10987441
2-tert-butyl-4-(oxan-2-yloxy)phenol
CID 12842791
2-hydroxy-4-(oxan-2-yloxy)benzoic acid
CID 129079966
2-hydroxy-N-methoxy-N-methyl-4-(oxan-2-yloxy)benzamide
CID 129079902
(E)-1-[2-hydroxy-4-(oxan-2-yloxy)phenyl]-3-(4-methoxyphenyl)prop-2-en-1-one
CID 10808037
[2-ethoxy-5-[(2R)-oxan-2-yl]oxyphenyl]methanol
CID 99717398
2-(4-methoxyphenoxy)oxolane
CID 135060561
4-[1,1-bis[4-(oxan-2-yloxy)phenyl]ethyl]phenol
CID 170406702
(E)-1-(2-hydroxy-4-methoxyphenyl)-3-[3-methoxy-4-(oxan-2-yloxy)phenyl]prop-2-en-1-one
CID 146223495
2-[2-hydroxyimino-1-[4-(oxan-2-yloxy)phenyl]ethyl]-5-(oxan-2-yloxy)phenol
CID 173162017
9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol
CID 154680130

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-(oxan-2-yloxy)phenol?
The IUPAC name of 2-methoxy-5-(oxan-2-yloxy)phenol (CID 163802207) is 2-methoxy-5-(oxan-2-yloxy)phenol.
What is the SMILES notation for 2-methoxy-5-(oxan-2-yloxy)phenol?
The canonical SMILES for 2-methoxy-5-(oxan-2-yloxy)phenol is COc1ccc(OC2CCCCO2)cc1O.
What is the InChIKey of 2-methoxy-5-(oxan-2-yloxy)phenol?
The InChIKey is NFYUNEXPWUSASF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O4/c1-14-11-6-5-9(8-10(11)13)16-12-4-2-3-7-15-12/h5-6,8,12-13H,2-4,7H2,1H3.
What are the key properties of 2-methoxy-5-(oxan-2-yloxy)phenol?
2-methoxy-5-(oxan-2-yloxy)phenol has a molecular weight of 224.26 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-(oxan-2-yloxy)phenol is sourced from PubChem (CID 163802207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).